[(3S)-4-methylsulfonylmorpholin-3-yl]methanamine

C6H14N2O3S — CID 155354512

IUPAC[(3S)-4-methylsulfonylmorpholin-3-yl]methanamine
SMILESCS(=O)(=O)N1CCOC[C@@H]1CN
InChIInChI=1S/C6H14N2O3S/c1-12(9,10)8-2-3-11-5-6(8)4-7/h6H,2-5,7H2,1H3/t6-/m0/s1
InChIKeyRUHKMZRTHCXLGQ-LURJTMIESA-N
MW194.26 g/mol
LogP-1.39
Rot. Bonds2

About [(3S)-4-methylsulfonylmorpholin-3-yl]methanamine

[(3S)-4-methylsulfonylmorpholin-3-yl]methanamine (PubChem CID 155354512) has the molecular formula C6H14N2O3S and a molecular weight of 194.26 g/mol. Its IUPAC name is [(3S)-4-methylsulfonylmorpholin-3-yl]methanamine.

Molecular Properties

Compound Name[(3S)-4-methylsulfonylmorpholin-3-yl]methanamine
PubChem CID155354512
Molecular FormulaC6H14N2O3S
Molecular Weight194.26 g/mol
Exact Mass194.07
IUPAC Name[(3S)-4-methylsulfonylmorpholin-3-yl]methanamine
SMILESCS(=O)(=O)N1CCOC[C@@H]1CN
InChIInChI=1S/C6H14N2O3S/c1-12(9,10)8-2-3-11-5-6(8)4-7/h6H,2-5,7H2,1H3/t6-/m0/s1
InChIKeyRUHKMZRTHCXLGQ-LURJTMIESA-N
XLogP-1.39
TPSA72.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.26
LogP ≤ 5-1.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[(3S)-4-methylmorpholin-3-yl]methanamine
CID 66577079
tert-butyl (3S)-3-(aminomethyl)morpholine-4-carboxylate;hydrochloride
CID 84819306
(3S)-4-(azepan-1-ylsulfonyl)-3-ethylmorpholine
CID 70727495
(3R)-4-ethylsulfonyl-3-methylmorpholine
CID 106833772
N-[[4-(2-methylsulfonylethyl)morpholin-3-yl]methyl]propan-2-amine
CID 83100521
3-aminomorpholine-4-sulfonamide
CID 114959244
3-(hydroxymethyl)-N-propylmorpholine-4-sulfonamide
CID 114809867
3-amino-N-ethylmorpholine-4-sulfonamide
CID 114809058
(4-cyclohexylmorpholin-3-yl)methanamine
CID 83095873
N-propan-2-yl-4-sulfamoylmorpholine-3-carboxamide
CID 112573894
4-[(3-ethylmorpholin-4-yl)sulfonylmethyl]aniline
CID 43611643
2-(aminomethyl)-N-methyl-N-(oxolan-3-yl)piperidine-1-sulfonamide
CID 82745526

Frequently Asked Questions

What is the IUPAC name of [(3S)-4-methylsulfonylmorpholin-3-yl]methanamine?
The IUPAC name of [(3S)-4-methylsulfonylmorpholin-3-yl]methanamine (CID 155354512) is [(3S)-4-methylsulfonylmorpholin-3-yl]methanamine.
What is the SMILES notation for [(3S)-4-methylsulfonylmorpholin-3-yl]methanamine?
The canonical SMILES for [(3S)-4-methylsulfonylmorpholin-3-yl]methanamine is CS(=O)(=O)N1CCOC[C@@H]1CN.
What is the InChIKey of [(3S)-4-methylsulfonylmorpholin-3-yl]methanamine?
The InChIKey is RUHKMZRTHCXLGQ-LURJTMIESA-N. The full InChI is InChI=1S/C6H14N2O3S/c1-12(9,10)8-2-3-11-5-6(8)4-7/h6H,2-5,7H2,1H3/t6-/m0/s1.
What are the key properties of [(3S)-4-methylsulfonylmorpholin-3-yl]methanamine?
[(3S)-4-methylsulfonylmorpholin-3-yl]methanamine has a molecular weight of 194.26 g/mol, XLogP of -1.39, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(3S)-4-methylsulfonylmorpholin-3-yl]methanamine is sourced from PubChem (CID 155354512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).